CHEBI:186432 - Okanin 3,4-dimethyl ehter 4'-glucoside

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Okanin 3,4-dimethyl ehter 4'-glucoside
ChEBI ID CHEBI:186432
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C23H26O11
Net Charge 0
Average Mass 478.450
Monoisotopic Mass 478.14751
InChI InChI=1S/C23H26O11/c1-31-14-7-4-11(9-16(14)32-2)3-6-13(25)12-5-8-15(19(27)18(12)26)33-23-22(30)21(29)20(28)17(10-24)34-23/h3-9,17,20-24,26-30H,10H2,1-2H3/b6-3+/t17-,20-,21-,22-,23-/m1/s1
InChIKey FYXHSRBJYWBBHF-QUZQSYJISA-N
SMILES O1[C@@H]([C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1OC2=C(O)C(O)=C(C=C2)C(=O)/C=C/C3=CC(OC)=C(OC)C=C3)CO
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing Okanin 3,4-dimethyl ehter 4'-glucoside (CHEBI:186432) is a flavonoids (CHEBI:72544)
Okanin 3,4-dimethyl ehter 4'-glucoside (CHEBI:186432) is a glycoside (CHEBI:24400)
IUPAC Name
(E)-1-[2,3-dihydroxy-4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Manual Xrefs Databases
24845935 ChemSpider
LMPK12120173 LIPID MAPS
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